5-[(2,6-dimethoxyphenyl)carbonylamino]-4-ethyl-2,3-dimethyl-thiolane-2,4-dicarboxylic acid

Systemtic Name: 5-[(2,6-dimethoxyphenyl)carbonylamino]-4-ethyl-2,3-dimethyl-thiolane-2,4-dicarboxylic acid Openeye Name: 5-[(2,6-dimethoxybenzoyl)amino]-4-ethyl-2,3-dimethyl-tetrahydrothiophene-2,4-dicarboxylic acid CAS Name: 5-[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-4-ethyl-2,3-dimethylthiolane-2,4-dicarboxylic acid IUPAC Name: 5-[(2,6-dimethoxybenzoyl)amino]-4-ethyl-2,3-dimethylthiolane-2,4-dicarboxylic acid Traditional Name: 5-[(2,6-dimethoxybenzoyl)amino]-4-ethyl-2,3-dimethyl-tetrahydrothiophene-2,4-dicarboxylic acid Formula: C19H25NO7S MolecularWeight: 411.4693

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C(SC1NC(=O)C2=C(C=CC=C2OC)OC)(C)C(=O)O)C)C(=O)O

Isomeric SMILES

CCC1(C(C(SC1NC(=O)C2=C(C=CC=C2OC)OC)(C)C(=O)O)C)C(=O)O

InChI

InChI=1S/C19H25NO7S/c1-6-19(17(24)25)10(2)18(3,16(22)23)28-15(19)20-14(21)13-11(26-4)8-7-9-12(13)27-5/h7-10,15H,6H2,1-5H3,(H,20,21)(H,22,23)(H,24,25)